# generated using pymatgen data_Li5Fe2Ni5O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.09888232 _cell_length_b 5.09888232 _cell_length_c 9.78657891 _cell_angle_alpha 84.85796119 _cell_angle_beta 84.85796119 _cell_angle_gamma 120.58821324 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Fe2Ni5O12 _chemical_formula_sum 'Li5 Fe2 Ni5 O12' _cell_volume 215.41946434 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Li Li0 1 0.82363500 0.67554000 0.75075800 1.0 Li Li1 1 0.67411500 0.82866600 0.24590400 1.0 Li Li2 1 0.32446000 0.17636500 0.24924200 1.0 Li Li3 1 0.17133400 0.32588500 0.75409600 1.0 Li Li4 1 0.08242500 0.91757500 0.00000000 1.0 Fe Fe5 1 0.74913100 0.25086900 0.00000000 1.0 Fe Fe6 1 0.24493700 0.75506300 0.50000000 1.0 Ni Ni7 1 0.91433100 0.08566900 0.50000000 1.0 Ni Ni8 1 0.99900400 0.50564900 0.24595500 1.0 Ni Ni9 1 0.49435100 0.00099600 0.75404500 1.0 Ni Ni10 1 0.58337100 0.41662900 0.50000000 1.0 Ni Ni11 1 0.42049700 0.57950300 0.00000000 1.0 O O12 1 0.06037100 0.24170800 0.11471300 1.0 O O13 1 0.75829200 0.93962900 0.88528700 1.0 O O14 1 0.87820200 0.37255300 0.62196500 1.0 O O15 1 0.62744700 0.12179800 0.37803500 1.0 O O16 1 0.69195500 0.52674000 0.11707700 1.0 O O17 1 0.47326000 0.30804500 0.88292300 1.0 O O18 1 0.55768500 0.73895000 0.61255400 1.0 O O19 1 0.26105000 0.44231500 0.38744600 1.0 O O20 1 0.38973200 0.85275500 0.11508900 1.0 O O21 1 0.14724500 0.61026800 0.88491100 1.0 O O22 1 0.20916100 0.03599000 0.62310300 1.0 O O23 1 0.96401000 0.79083900 0.37689700 1.0